5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide
TL;DR: 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide (CAS 82018-13-1) is a chemical compound with molecular formula C10H11Br3N2O2 and molecular weight 427.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,8-dibromo-2-(bromomethyl)-3-methyl-4-oxido-5,6,7,8-tetrahydroquinoxalin-1-ium 1-oxide
Also Known As: 5,8-dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide, 5,8-dibromo-2-(bromomethyl)-3-methyl-4-oxido-5,6,7,8-tetrahydroquinoxalin-1-ium 1-oxide, 5,8-Dibromo-2-bromomethyl-3-methyl-5,6,7,8-tetrahydro-quinoxaline 1,4-dioxide
| Molecular Formula | C10H11Br3N2O2 |
|---|---|
| Molecular Weight | 427.84 g/mol |
| LogP | 3.61762 |
| Topological Polar Surface Area | 50.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 427.83707 |
| Heavy Atoms | 17 |
| Complexity | 515.253 |
Chemical Identifiers
| CAS Number | 82018-13-1 |
|---|---|
| SMILES | CC1=C([N+](=O)C2=C(N1[O-])C(CCC2Br)Br)CBr |
Product Overview
5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide (CAS 82018-13-1), with molecular formula C10H11Br3N2O2 and molecular weight 427.84 g/mol. IUPAC: 5,8-dibromo-2-(bromomethyl)-3-methyl-4-oxido-5,6,7,8-tetrahydroquinoxalin-1-ium 1-oxide.
Chemical Property Profile of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide
Property Insights of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide
The XLogP value of 3.61762 indicates that 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.96 Ų, 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide?
The CAS number of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide is 82018-13-1.
What is the molecular formula of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide?
The molecular formula of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide is C10H11Br3N2O2.
What is the molecular weight of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide?
The molecular weight of 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide is 427.84 g/mol.
Where can I buy 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide?
You can request a quote for 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 5,8-Dibromo-2-(bromomethyl)-3-methyl-5,6,7,8-tetrahydroquinoxaline 1,4-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.